7-bromanyl-6-methyl-5-(4-methylphenyl)carbonyl-2,3-dihydropyrrolizine-1,1-dicarboxylate

Systemtic Name: 7-bromanyl-6-methyl-5-(4-methylphenyl)carbonyl-2,3-dihydropyrrolizine-1,1-dicarboxylate Openeye Name: 7-bromo-6-methyl-5-(4-methylbenzoyl)-2,3-dihydropyrrolizine-1,1-dicarboxylate CAS Name: 7-bromo-6-methyl-5-[(4-methylphenyl)-oxomethyl]-2,3-dihydropyrrolizine-1,1-dicarboxylate IUPAC Name: 7-bromo-6-methyl-5-(4-methylbenzoyl)-2,3-dihydropyrrolizine-1,1-dicarboxylate Traditional Name: 7-bromo-6-methyl-5-p-toluoyl-2,3-dihydropyrrolizine-1,1-dicarboxylate Formula: C18H14BrNO5-2 MolecularWeight: 404.21146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2CCC3(C(=O)[O-])C(=O)[O-])Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2CCC3(C(=O)[O-])C(=O)[O-])Br)C

InChI

InChI=1S/C18H16BrNO5/c1-9-3-5-11(6-4-9)14(21)13-10(2)12(19)15-18(16(22)23,17(24)25)7-8-20(13)15/h3-6H,7-8H2,1-2H3,(H,22,23)(H,24,25)/p-2